Butanenitrile, 4-imino-4-methoxy-
methyl 3-cyanopropanimidate
Also Known As: methyl 3-cyanopropanimidate|Methyl 3-cyanopropanimidoate|Methyl 3-cyanopropanimidoate #|methyl(1z)-3-cyanopropanimidoate|Butanenitrile,4-imino-4-methoxy-|Butanenitrile, 4-imino-4-methoxy-
CAS: 99418-75-4
| Molecular Formula | C5H8N2O |
|---|---|
| Molecular Weight | 112.06366 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.06366 |
| Monoisotopic Mass | 112.06366 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 99418-75-4 |
|---|---|
| SMILES | COC(=N)CCC#N |
| InChIKey | JRPNVSLDPLKLCT-UHFFFAOYSA-N |
Product Overview
Butanenitrile, 4-imino-4-methoxy- (CAS 99418-75-4), with molecular formula C5H8N2O and molecular weight 112.06366 g/mol. IUPAC: methyl 3-cyanopropanimidate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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